CHEBI:74774 - 5-[2-(feruloyl)ethen-1-yl]thalidomide

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ChEBI Name 5-[2-(feruloyl)ethen-1-yl]thalidomide ChEBI ID CHEBI:74774 Definition A dicarboximide that is thalidomide substituted at position 5 by an ethenyl group, which in turn is substituted by a feruloyl group at position 2. The compound is a hybrid based on the structures of thalidomide and curcumin and has been found to exhibit cytotoxicity against human multiple myeloma cells. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C25H20N2O7 Net Charge 0 Average Mass 460.43550 Monoisotopic Mass 460.12705 InChI InChI=1S/C25H20N2O7/c1-34-21-13-15(5-10-20(21)29)3-7-16(28)6-2-14-4-8-17-18(12-14)25(33)27(24(17)32)19-9-11-22(30)26-23(19)31/h2-8,10,12-13,19,29H,9,11H2,1H3,(H,26,30,31)/b6-2+,7-3+ InChIKey HEMJTXBCAXHSBV-YPCIICBESA-N SMILES COc1cc(\C=C\C(=O)\C=C\c2ccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c3c2)ccc1O Roles Classification Application(s): antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. View more via ChEBI Ontology ChEBI Ontology Outgoing 5-[2-(feruloyl)ethen-1-yl]thalidomide (CHEBI:74774) has functional parent thalidomide (CHEBI:9513) 5-[2-(feruloyl)ethen-1-yl]thalidomide (CHEBI:74774) has role antineoplastic agent (CHEBI:35610) 5-[2-(feruloyl)ethen-1-yl]thalidomide (CHEBI:74774) is a aromatic ether (CHEBI:35618) 5-[2-(feruloyl)ethen-1-yl]thalidomide (CHEBI:74774) is a dicarboximide (CHEBI:35356) 5-[2-(feruloyl)ethen-1-yl]thalidomide (CHEBI:74774) is a enone (CHEBI:51689) 5-[2-(feruloyl)ethen-1-yl]thalidomide (CHEBI:74774) is a isoindoles (CHEBI:24897) 5-[2-(feruloyl)ethen-1-yl]thalidomide (CHEBI:74774) is a phenols (CHEBI:33853) 5-[2-(feruloyl)ethen-1-yl]thalidomide (CHEBI:74774) is a piperidones (CHEBI:48589) IUPAC Name 2-(2,6-dioxopiperidin-3-yl)-5-[(1E,4E)-5-(4-hydroxy-3-methoxyphenyl)-3-oxopenta-1,4-dien-1-yl]-1H-isoindole-1,3(2H)-dione Synonym Source 5-[(1E,4E)-5-(4-hydroxy-3-methoxyphenyl)-3-oxopenta-1,4-dien-1-yl]thalidomide ChEBI Citation Type Source 23784627 PubMed citation Europe PMC Last Modified 24 July 2013